![4,6-Dichlorobenzo[d]oxazole-2-thiol structure](/static/products/2189/218930-35-9.webp)
4,6-Dichlorobenzo[d]oxazole-2-thiol
TL;DR: 4,6-Dichlorobenzo[d]oxazole-2-thiol (CAS 218930-35-9) is a chemical compound with molecular formula C7H3Cl2NOS and molecular weight 218.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,6-dichloro-3H-1,3-benzoxazole-2-thione
Also Known As: 4,6-Dichlorobenzo[d]oxazole-2-thiol, 4,6-Dichloro-benzooxazole-2-thiol, 4,6-dichloro-3H-1,3-benzoxazole-2-thione
| Molecular Formula | C7H3Cl2NOS |
|---|---|
| Molecular Weight | 218.93 g/mol |
| LogP | 3.79719 |
| Topological Polar Surface Area | 28.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 218.93124 |
| Heavy Atoms | 12 |
| Complexity | 487.6023 |
Chemical Identifiers
| CAS Number | 218930-35-9 |
|---|---|
| SMILES | C1=C(C=C(C2=C1OC(=S)N2)Cl)Cl |
Product Overview
4,6-Dichlorobenzo[d]oxazole-2-thiol (CAS 218930-35-9), with molecular formula C7H3Cl2NOS and molecular weight 218.93 g/mol. IUPAC: 4,6-dichloro-3H-1,3-benzoxazole-2-thione.
Chemical Property Profile of 4,6-Dichlorobenzo[d]oxazole-2-thiol
Property Insights of 4,6-Dichlorobenzo[d]oxazole-2-thiol
The XLogP value of 3.79719 indicates that 4,6-Dichlorobenzo[d]oxazole-2-thiol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.93 Ų, 4,6-Dichlorobenzo[d]oxazole-2-thiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,6-Dichlorobenzo[d]oxazole-2-thiol has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4,6-Dichlorobenzo[d]oxazole-2-thiol?
The CAS number of 4,6-Dichlorobenzo[d]oxazole-2-thiol is 218930-35-9.
What is the molecular formula of 4,6-Dichlorobenzo[d]oxazole-2-thiol?
The molecular formula of 4,6-Dichlorobenzo[d]oxazole-2-thiol is C7H3Cl2NOS.
What is the molecular weight of 4,6-Dichlorobenzo[d]oxazole-2-thiol?
The molecular weight of 4,6-Dichlorobenzo[d]oxazole-2-thiol is 218.93 g/mol.
Where can I buy 4,6-Dichlorobenzo[d]oxazole-2-thiol?
You can request a quote for 4,6-Dichlorobenzo[d]oxazole-2-thiol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,6-Dichlorobenzo[d]oxazole-2-thiol?
Yes, KEHONG BIO provides custom synthesis services for 4,6-Dichlorobenzo[d]oxazole-2-thiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.